6-(1-hydroxyethyl)-7-oxidanylidene-3-prop-2-enylsulfanylcarbonyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 6-(1-hydroxyethyl)-7-oxidanylidene-3-prop-2-enylsulfanylcarbonyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 3-allylsulfanylcarbonyl-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-(1-hydroxyethyl)-7-oxo-3-[oxo-(prop-2-enylthio)methyl]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-(1-hydroxyethyl)-7-oxo-3-prop-2-enylsulfanylcarbonyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 3-(allylthio)carbonyl-6-(1-hydroxyethyl)-7-keto-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C12H15NO5S2 MolecularWeight: 317.3812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2N(C1=O)C(C(S2)C(=O)SCC=C)C(=O)O)O

Isomeric SMILES

CC(C1C2N(C1=O)C(C(S2)C(=O)SCC=C)C(=O)O)O

InChI

InChI=1S/C12H15NO5S2/c1-3-4-19-12(18)8-7(11(16)17)13-9(15)6(5(2)14)10(13)20-8/h3,5-8,10,14H,1,4H2,2H3,(H,16,17)